BUX9R8 -OEChem-04022115493D 57 59 0 1 0 0 0 0 0999 V2000 -0.8827 -1.8198 1.5616 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9277 3.1086 1.0859 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9536 -1.2668 -0.4226 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3266 -2.8888 -0.4212 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3135 -1.1356 -1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5677 1.1234 -0.5267 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8296 -0.2525 0.1196 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5723 2.1675 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2738 0.3606 0.4606 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2879 -0.6917 -0.0589 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0171 1.7152 -0.2075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1397 1.6121 -0.2629 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7152 -0.0898 0.2297 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8772 2.9158 -1.0099 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9065 1.7896 1.2338 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -1.9763 0.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6874 -3.7567 0.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0575 -3.5348 -0.5062 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5824 -2.1353 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 -1.6044 0.7075 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5643 -0.2282 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9007 0.0402 -0.7862 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 0.8184 1.0535 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8951 1.3078 -1.3789 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2605 2.0915 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5892 2.3301 -0.7256 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7023 1.0205 -1.6133 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 -0.1972 1.2012 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 2.3693 1.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4573 3.1199 -0.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1252 0.4718 1.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4844 -0.8912 -1.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4518 -1.6427 0.4648 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2376 1.6524 -1.2809 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 2.4719 0.2106 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4261 0.8705 -0.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0059 -1.4676 -1.4167 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9268 -0.2190 -0.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4205 0.6471 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9087 -1.0439 0.7313 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3994 3.7711 -0.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1603 2.8359 -2.0646 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 3.1545 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0624 0.8826 1.8188 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 2.0649 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 2.6009 1.6744 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5554 -2.9789 -1.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3597 -4.7844 -0.0598 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7464 -3.6232 1.2156 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7725 -4.2494 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0051 -3.7437 -1.5825 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7291 -2.1466 1.5653 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7613 -1.2410 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7801 0.6325 1.9875 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.4949 -2.3101 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5997 3.3251 -1.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3352 2.7714 1.9022 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 25 1 0 0 0 0 2 57 1 0 0 0 0 3 7 1 0 0 0 0 3 16 1 0 0 0 0 3 37 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 4 47 1 0 0 0 0 5 19 1 0 0 0 0 5 22 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 27 1 0 0 0 0 7 10 1 0 0 0 0 7 28 1 0 0 0 0 8 11 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 36 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 2 0 0 0 0 23 54 1 0 0 0 0 24 26 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 26 56 1 0 0 0 0 M END $$$$